2-(1-adamantyl)-4-chloranyl-5-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridazin-3-one

Systemtic Name: 2-(1-adamantyl)-4-chloranyl-5-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridazin-3-one Openeye Name: 2-(1-adamantyl)-4-chloro-5-(3-chloro-4-fluoro-anilino)pyridazin-3-one CAS Name: 2-(1-adamantyl)-4-chloro-5-(3-chloro-4-fluoroanilino)-3-pyridazinone IUPAC Name: 2-(1-adamantyl)-4-chloro-5-(3-chloro-4-fluoroanilino)pyridazin-3-one Traditional Name: 2-(1-adamantyl)-4-chloro-5-(3-chloro-4-fluoro-anilino)pyridazin-3-one Formula: C20H20Cl2FN3O MolecularWeight: 408.296703

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=CC(=C(C=C5)F)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=CC(=C(C=C5)F)Cl)Cl

InChI

InChI=1S/C20H20Cl2FN3O/c21-15-6-14(1-2-16(15)23)25-17-10-24-26(19(27)18(17)22)20-7-11-3-12(8-20)5-13(4-11)9-20/h1-2,6,10-13,25H,3-5,7-9H2